According to the closed-orbit theory, we study the influence of elastic interface on the photodetachment of H- near a metallic sphere surface. First, we give a clear physical description of the detached electron movem...According to the closed-orbit theory, we study the influence of elastic interface on the photodetachment of H- near a metallic sphere surface. First, we give a clear physical description of the detached electron movement between the elastic interface and the metallic sphere surface. Then we put forward an analytical formula for calculating the photodetachment cross section of this system. Our study suggests that the photodetachment cross section of H is changed with the distance between the elastic interface and H^-. Compared with the photodetachment cross section of H^- near a metallic sphere surface without the elastic interface, the cross section of our system oscillates and its oscillation is strengthened with the decrease of the distance from the elastic interface to H^-. In additon, our calcuation results suggest that the influence of the elastic interface becomes much more significant when it is located in the lower half space rather than in the upper half space. Therefore, we can control the photodetachment of H^- near a metallic sphere surface by changing the position of the elastic interface. We hope that our work is conducive to the understanding of the photodetachment process of negative ions near interfaces, cavities and ion traps.展开更多
First-principles calculations by means of the full-potential linearized augmented plane wave method using the generalized gradient approximation with correlation effect correction（GGA＋U） within the framework of spi...First-principles calculations by means of the full-potential linearized augmented plane wave method using the generalized gradient approximation with correlation effect correction（GGA＋U） within the framework of spin polarized density functional theory（DFT＋U） are used to study the structural,electronic,and magnetic properties of cubic perovskite compounds RbXF3（X = Mn,V,Co,and Fe）.It is found that the calculated structural parameters,i.e.,lattice constant,bulk modulus,and its pressure derivative are in good agreement with the previous results.Our results reveal that the strong spin polarization of the 3d states of the X atoms is the origin of ferromagnetism in RbXF3.Cohesive energies and the magnetic moments of RbXF3 have also been calculated.The calculated electronic properties show the half-metallic nature of RbCoF3 and RbFeF3,making these materials suitable for spintronic applications.展开更多
基金Project supported by the National Natural Science Foundation of China (Grant Nos.11074104 and 11374133)the Shandong Provincial Higher Educational Science and Technology Program,China (Grant No.J13LJ04)
文摘According to the closed-orbit theory, we study the influence of elastic interface on the photodetachment of H- near a metallic sphere surface. First, we give a clear physical description of the detached electron movement between the elastic interface and the metallic sphere surface. Then we put forward an analytical formula for calculating the photodetachment cross section of this system. Our study suggests that the photodetachment cross section of H is changed with the distance between the elastic interface and H^-. Compared with the photodetachment cross section of H^- near a metallic sphere surface without the elastic interface, the cross section of our system oscillates and its oscillation is strengthened with the decrease of the distance from the elastic interface to H^-. In additon, our calcuation results suggest that the influence of the elastic interface becomes much more significant when it is located in the lower half space rather than in the upper half space. Therefore, we can control the photodetachment of H^- near a metallic sphere surface by changing the position of the elastic interface. We hope that our work is conducive to the understanding of the photodetachment process of negative ions near interfaces, cavities and ion traps.
文摘First-principles calculations by means of the full-potential linearized augmented plane wave method using the generalized gradient approximation with correlation effect correction（GGA＋U） within the framework of spin polarized density functional theory（DFT＋U） are used to study the structural,electronic,and magnetic properties of cubic perovskite compounds RbXF3（X = Mn,V,Co,and Fe）.It is found that the calculated structural parameters,i.e.,lattice constant,bulk modulus,and its pressure derivative are in good agreement with the previous results.Our results reveal that the strong spin polarization of the 3d states of the X atoms is the origin of ferromagnetism in RbXF3.Cohesive energies and the magnetic moments of RbXF3 have also been calculated.The calculated electronic properties show the half-metallic nature of RbCoF3 and RbFeF3,making these materials suitable for spintronic applications.
